Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc2ccc(NC(=O)Nc1ccc(C(=[N@H])N)cc1)cc2 |
SMILES_CANONICAL | CACTVS | 3.341 | NC(=N)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 |
SMILES | CACTVS | 3.341 | NC(=N)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [H]/N=C(\c1ccc(cc1)NC(=O)Nc2ccc(cc2)Cl)/N |
SMILES | OpenEye OEToolkits | 1.5.0 | [H]N=C(c1ccc(cc1)NC(=O)Nc2ccc(cc2)Cl)N |
InChI | InChI | 1.03 | InChI=1S/C14H13ClN4O/c15-10-3-7-12(8-4-10)19-14(20)18-11-5-1-9(2-6-11)13(16)17/h1-8H,(H3,16,17)(H2,18,19,20) |
InChIKey | InChI | 1.03 | HQWKMDKTTCPCMQ-UHFFFAOYSA-N |